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	hartrees
Energy at 0K	-139.407942
Energy at 298.15K	-139.410983
HF Energy	-139.072587
Nuclear repulsion energy	37.500330

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3115	2882	27.55
2	A₁	1562	1446	5.20
3	A₁	1126	1042	105.88
4	E	3204	2965	46.04
4	E	3204	2965	46.04
5	E	1559	1442	3.57
5	E	1559	1442	3.57
6	E	1247	1153	1.55
6	E	1247	1153	1.55

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.629
F2	0.000	0.000	0.747
H3	0.000	1.030	-0.982
H4	0.892	-0.515	-0.982
H5	-0.892	-0.515	-0.982

	C1	F2	H3	H4	H5
C1		1.3761	1.0890	1.0890	1.0890
F2	1.3761		2.0128	2.0128	2.0128
H3	1.0890	2.0128		1.7843	1.7843
H4	1.0890	2.0128	1.7843		1.7843
H5	1.0890	2.0128	1.7843	1.7843

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	H3	108.923	F2	C1	H4	108.923
F2	C1	H5	108.923	H3	C1	H4	110.014
H3	C1	H5	110.014	H4	C1	H5	110.014

All results from a given calculation for CH₃F (Methyl fluoride)

using model chemistry: CISD/6-311G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CH3F (Methyl fluoride)

using model chemistry: CISD/6-311G*

States and conformations

All results from a given calculation for CH₃F (Methyl fluoride)